N-[4-(azepan-1-yl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-4-methylsulfanyl-benzamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-methoxy-4-(methylthio)benzamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-4-methylsulfanylbenzamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-4-(methylthio)benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C21H26N2O2S/c1-25-20-15-18(26-2)11-12-19(20)21(24)22-16-7-9-17(10-8-16)23-13-5-3-4-6-14-23/h7-12,15H,3-6,13-14H2,1-2H3,(H,22,24)